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7,11-Dimethyldodeca-6,10-dien-3-one

HCID 54367481
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Basic information

CAS
61252-18-4
Standard SMILES
CCC(=O)CCC=C(C)CCC=C(C)C
InChIKey
UQTSSEGRUWAYCR-UHFFFAOYSA-N
Molecular formula
C14H24O
Average molar mass
208.34 g/mol
Monoisotopic mass
208.18271539

Names & identifiers

Preferred name
7,11-Dimethyldodeca-6,10-dien-3-one
IUPAC
7,11-dimethyldodeca-6,10-dien-3-one

Names & synonyms

7,11-Dimethyldodeca-6,10-dien-3-one61252-18-4SCHEMBL726071DTXSID60710870

Database identifiers

CAS
61252-18-4
PubChem CID
54367481
DTXSID
DTXSID60710870

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
7
Heavy atoms
15
Formal charge
0
Complexity
242

Related reactions

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Compound notes

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